N-(4-bromophenyl)-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(4-bromophenyl)-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]acetamide CAS Name: N-(4-bromophenyl)-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]acetamide IUPAC Name: N-(4-bromophenyl)-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4-bromophenyl)-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]acetamide Formula: C12H11BrN4O3S MolecularWeight: 371.20974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)SCC(=O)NC2=CC=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)SCC(=O)NC2=CC=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H11BrN4O3S/c1-7-11(17(19)20)12(16-15-7)21-6-10(18)14-9-4-2-8(13)3-5-9/h2-5H,6H2,1H3,(H,14,18)(H,15,16)